./iterations/neb0_image09_iter176_OSZICAR.out output for 44: 750-->752: Si-OH + Si-H , to Si-O-SI + H2 (TSS)
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.374005031975E+03 0.37401E+03 -0.14280E+04 624 0.799E+02
DAV: 2 0.322389052923E+01 -0.37078E+03 -0.35803E+03 869 0.196E+02
DAV: 3 -0.967187266625E+02 -0.99943E+02 -0.99611E+02 661 0.117E+02
DAV: 4 -0.101253173621E+03 -0.45344E+01 -0.45239E+01 720 0.287E+01
DAV: 5 -0.101342136812E+03 -0.88963E-01 -0.88923E-01 728 0.365E+00 0.227E+01
DAV: 6 -0.926795828477E+02 0.86626E+01 -0.30949E+01 717 0.301E+01 0.119E+01
DAV: 7 -0.918098284221E+02 0.86975E+00 -0.17147E+00 728 0.614E+00 0.480E+00
DAV: 8 -0.914334801862E+02 0.37635E+00 -0.54652E-01 712 0.396E+00 0.163E+00
DAV: 9 -0.913520264691E+02 0.81454E-01 -0.13086E-01 712 0.155E+00 0.424E-01
DAV: 10 -0.913436313825E+02 0.83951E-02 -0.43805E-02 760 0.110E+00 0.298E-01
DAV: 11 -0.913479789496E+02 -0.43476E-02 -0.11627E-02 616 0.559E-01 0.133E-01
DAV: 12 -0.913512296003E+02 -0.32507E-02 -0.28958E-03 634 0.247E-01 0.111E-01
DAV: 13 -0.913546994612E+02 -0.34699E-02 -0.12211E-03 693 0.195E-01 0.429E-02
DAV: 14 -0.913578080680E+02 -0.31086E-02 -0.64490E-04 664 0.136E-01 0.371E-02
DAV: 15 -0.913594110029E+02 -0.16029E-02 -0.15603E-04 712 0.818E-02 0.329E-02
DAV: 16 -0.913608394426E+02 -0.14284E-02 -0.31522E-04 656 0.850E-02 0.172E-02
DAV: 17 -0.913612745695E+02 -0.43513E-03 -0.76464E-05 752 0.593E-02 0.127E-02
DAV: 18 -0.913614971152E+02 -0.22255E-03 -0.34726E-05 576 0.258E-02 0.978E-03
DAV: 19 -0.913615464998E+02 -0.49385E-04 -0.90255E-06 504 0.172E-02 0.452E-03
DAV: 20 -0.913615775625E+02 -0.31063E-04 -0.83091E-06 421 0.181E-02 0.213E-03
DAV: 21 -0.913615929665E+02 -0.15404E-04 -0.24881E-06 461 0.773E-03 0.227E-03
DAV: 22 -0.913615982113E+02 -0.52448E-05 -0.81758E-07 448 0.574E-03
1 F= -.91361598E+02 E0= -.91366411E+02 d E =0.144381E-01